[email protected]
CAS 926262-97-7 N-(4-aminophenyl)-2-chloro-4-fluorobenzamide molecular structure lightbox
CAS RN: 926262-97-7

N-(4-aminophenyl)-2-chloro-4-fluorobenzamide

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260221 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS926262-97-7
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

926262-97-7 / N-(4-aminophenyl)-2-chloro-4-fluorobenzamide

Standard CAS: 926262-97-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
926262-97-7
Multi CAS
No
Molecular Formula
C13H10CLFN2O
Molecular Weight
264.680000
Exact Mass
264.046569
InChI
InChI=1S/C13H10ClFN2O/c14-12-7-8(15)1-6-11(12)13(18)17-10-4-2-9(16)3-5-10/h1-7H,16H2,(H,17,18)
InChIKey
AWTUMPRZZGVUIC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
12
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
70.22
TPSA
55.12

LogP / Solubility

WLOGP
3.31
MLOGP
2.92
XLogP3
2.8
Consensus LogP
3.01
Log S (ESOL)
-3.93
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.12
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.37
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.98

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us